3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)

C188H242Br2Cl6F2N50O5 — CID 165103633

About 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)

3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine) (PubChem CID 165103633) has the molecular formula C188H242Br2Cl6F2N50O5 and a molecular weight of 3692.87 g/mol. Its IUPAC name is 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine).

Molecular Properties

• Compound Name: 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)
• PubChem CID: 165103633
• Molecular Formula: C188H242Br2Cl6F2N50O5
• Molecular Weight: 3692.87 g/mol
• Exact Mass: 3685.67
• IUPAC Name: 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)
• SMILES: CC(C)c1ncnc2c(Br)nn(C)c12.CC(C)c1ncnc2c(Cl)cn(C)c12.CC(C)c1ncnc2c(Cl)nn(C)c12.CC(C)c1ncnc2c(F)cn(C)c12.CC(C)c1ncnc2c(F)nn(C)c12.COc1cc(C)c2c(C(C)C)c(C)cnn12.COc1cc(C)c2c(C(C)C)nc(C)nn12.COc1cc(C)c2c(C(C)C)nc(C)nn12.COc1cn2nc(C)nc(C(C)C)c2c1C.COc1cn2ncc(C)c(C(C)C)c2c1C.Cc1cc(Br)n2ncnc(C(C)C)c12.Cc1cnn2c(Cl)cc(C)c2c1C(C)C.Cc1cnn2cc(Cl)c(C)c2c1C(C)C.Cc1cnn2ccc(C)c2c1C(C)C.Cc1nc(C(C)C)c2c(C)c(Cl)cn2n1.Cc1nc(C(C)C)c2c(C)cc(Cl)n2n1.[C-]#[N+]c1cn2ncnc(C(C)C)c2c1C
• InChI: InChI=1S/2C13H18N2O.2C12H15ClN2.3C12H17N3O.C12H16N2.2C11H14ClN3.C11H12N4.C10H12BrN3.C10H12ClN3.C10H12FN3.C9H11BrN4.C9H11ClN4.C9H11FN4/c1-8(2)12-9(3)6-14-15-7-11(16-5)10(4)13(12)15;1-8(2)12-10(4)7-14-15-11(16-5)6-9(3)13(12)15;1-7(2)11-8(3)5-14-15-6-10(13)9(4)12(11)15;1-7(2)11-9(4)6-14-15-10(13)5-8(3)12(11)15;1-7(2)11-12-8(3)10(16-5)6-15(12)14-9(4)13-11;2*1-7(2)11-12-8(3)6-10(16-5)15(12)14-9(4)13-11;1-8(2)11-10(4)7-13-14-6-5-9(3)12(11)14;1-6(2)10-11-7(3)9(12)5-15(11)14-8(4)13-10;1-6(2)10-11-7(3)5-9(12)15(11)14-8(4)13-10;1-7(2)10-11-8(3)9(12-4)5-15(11)14-6-13-10;1-6(2)9-10-7(3)4-8(11)14(10)13-5-12-9;2*1-6(2)8-10-9(13-5-12-8)7(11)4-14(10)3;3*1-5(2)6-8-7(12-4-11-6)9(10)13-14(8)3/h2*6-8H,1-5H3;2*5-7H,1-4H3;3*6-7H,1-5H3;5-8H,1-4H3;2*5-6H,1-4H3;5-7H,1-3H3;3*4-6H,1-3H3;3*4-5H,1-3H3
• InChIKey: YTMOHOWQKTWHHH-UHFFFAOYSA-N
• XLogP: 47.00
• TPSA: 540.56 Ų
• H-Bond Acceptors: 54
• Rotatable Bonds: 22
• Heavy Atoms: 253
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3692.87
LogP ≤ 5	47.00
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	54

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)?

The IUPAC name of 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine) (CID 165103633) is 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine).

What is the SMILES notation for 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)?

The canonical SMILES for 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine) is CC(C)c1ncnc2c(Br)nn(C)c12.CC(C)c1ncnc2c(Cl)cn(C)c12.CC(C)c1ncnc2c(Cl)nn(C)c12.CC(C)c1ncnc2c(F)cn(C)c12.CC(C)c1ncnc2c(F)nn(C)c12.COc1cc(C)c2c(C(C)C)c(C)cnn12.COc1cc(C)c2c(C(C)C)nc(C)nn12.COc1cc(C)c2c(C(C)C)nc(C)nn12.COc1cn2nc(C)nc(C(C)C)c2c1C.COc1cn2ncc(C)c(C(C)C)c2c1C.Cc1cc(Br)n2ncnc(C(C)C)c12.Cc1cnn2c(Cl)cc(C)c2c1C(C)C.Cc1cnn2cc(Cl)c(C)c2c1C(C)C.Cc1cnn2ccc(C)c2c1C(C)C.Cc1nc(C(C)C)c2c(C)c(Cl)cn2n1.Cc1nc(C(C)C)c2c(C)cc(Cl)n2n1.[C-]#[N+]c1cn2ncnc(C(C)C)c2c1C.

What is the InChIKey of 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)?

The InChIKey is YTMOHOWQKTWHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H18N2O.2C12H15ClN2.3C12H17N3O.C12H16N2.2C11H14ClN3.C11H12N4.C10H12BrN3.C10H12ClN3.C10H12FN3.C9H11BrN4.C9H11ClN4.C9H11FN4/c1-8(2)12-9(3)6-14-15-7-11(16-5)10(4)13(12)15;1-8(2)12-10(4)7-14-15-11(16-5)6-9(3)13(12)15;1-7(2)11-8(3)5-14-15-6-10(13)9(4)12(11)15;1-7(2)11-9(4)6-14-15-10(13)5-8(3)12(11)15;1-7(2)11-12-8(3)10(16-5)6-15(12)14-9(4)13-11;2*1-7(2)11-12-8(3)6-10(16-5)15(12)14-9(4)13-11;1-8(2)11-10(4)7-13-14-6-5-9(3)12(11)14;1-6(2)10-11-7(3)9(12)5-15(11)14-8(4)13-10;1-6(2)10-11-7(3)5-9(12)15(11)14-8(4)13-10;1-7(2)10-11-8(3)9(12-4)5-15(11)14-6-13-10;1-6(2)9-10-7(3)4-8(11)14(10)13-5-12-9;2*1-6(2)8-10-9(13-5-12-8)7(11)4-14(10)3;3*1-5(2)6-8-7(12-4-11-6)9(10)13-14(8)3/h2*6-8H,1-5H3;2*5-7H,1-4H3;3*6-7H,1-5H3;5-8H,1-4H3;2*5-6H,1-4H3;5-7H,1-3H3;3*4-6H,1-3H3;3*4-5H,1-3H3.

What are the key properties of 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine)?

3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine) has a molecular weight of 3692.87 g/mol, XLogP of 47.00, 22 rotatable bonds, 0 hydrogen bond donors, and 54 hydrogen bond acceptors.

Where does this data come from?

All data for 3-bromo-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-bromo-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-chloro-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;7-chloro-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;3-chloro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-chloro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;3-fluoro-1-methyl-7-propan-2-ylpyrazolo[4,5-d]pyrimidine;7-fluoro-5-methyl-4-propan-2-ylpyrrolo[3,2-d]pyrimidine;6-isocyano-5-methyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;6-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;7-methoxy-3,5-dimethyl-4-propan-2-ylpyrrolo[1,2-b]pyridazine;6-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine;bis(7-methoxy-2,5-dimethyl-4-propan-2-ylpyrrolo[2,1-f][1,2,4]triazine) is sourced from PubChem (CID 165103633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).